Vitas-M small molecule compound
prop-2-en-1-yl 2-{(3E)-2-(2,5-dimethoxyphenyl)-3-[hydroxy(4-methoxy-2-methylphenyl)methylidene]-4,5-dioxopyrrolidin-1-yl}-4-methyl-1,3-thiazole-5-carboxylate
Catalog ID
STL049749
SMILES C=CCOC(=O)c1sc(nc1C)N1C(=O)C(=O)/C(=C(\c2ccc(cc2C)OC)/O)/C1c1cc(OC)ccc1OC
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C29H28N2O8S MW 564.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H28N2O8S/c1-7-12-39-28(35)26-16(3)30-29(40-26)31-23(20-14-18(37-5)9-11-21(20)38-6)22(25(33)27(31)34)24(32)19-10-8-17(36-4)13-15(19)2/h7-11,13-14,23,32H,1,12H2,2-6H3/b24-22+InChIKey
XUMCRVHHLBBGQT-ZNTNEXAZSA-NSynonyms
C=CCOC(=O)c1sc(nc1C)N1C(=O)C(=O)C(=C(c2ccc(cc2C)OC)O)C1c1cc(OC)ccc1OC
CC1=C(C=CC(=C1)OC)C(=C2C(N(C(=O)C2=O)C3=NC(=C(S3)C(=O)OCC=C)C)C4=C(C=CC(=C4)OC)OC)O
InChI=1SC29H28N2O8Sc17123928(35)2616(3)3029(4026)3123(201418(375)91121(20)386)22(25(33)27(31)34)24(32)1910817(364)1315(19)2h71113142332H112H226H3b2422+
MFCD05725113
prop2en1yl2((3E)2(25dimethoxyphenyl)3(hydroxy(4methoxy2methylphenyl)methylidene)45dioxopyrrolidin1yl)4methyl13thiazole5carboxylate
PROP2ENYL2((3E)2(25DIMETHOXYPHENYL)3(HYDROXY(4METHOXY2METHYLPHENYL)METHYLIDENE)45DIOXOPYRROLIDIN1YL)4METHYL13THIAZOLE5CARBOXYLATE
ZINC000101276763
ZINC000101276767
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Check stock on Vitas-MAvailable files
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